O2,O4-dimethyl O1-(phenylmethyl) (2S)-pyrrolidine-1,2,4-tricarboxylate

Systemtic Name: O2,O4-dimethyl O1-(phenylmethyl) (2S)-pyrrolidine-1,2,4-tricarboxylate Openeye Name: O1-benzyl O2,O4-dimethyl (2S)-pyrrolidine-1,2,4-tricarboxylate CAS Name: (2S)-pyrrolidine-1,2,4-tricarboxylic acid O2,O4-dimethyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O,4-O-dimethyl (2S)-pyrrolidine-1,2,4-tricarboxylate Traditional Name: (2S)-pyrrolidine-1,2,4-tricarboxylic acid O1-benzyl ester O2,O4-dimethyl ester Formula: C16H19NO6 MolecularWeight: 321.32516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)[C@@H]1CC(CN1C(=O)OCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H19NO6/c1-21-14(18)12-8-13(15(19)22-2)17(9-12)16(20)23-10-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3/t12?,13-/m0/s1